Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.30 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.30 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6047579 | 0.90 | GRIA1 (0.31) | GRIA1CACNG8 | |
| SCHEMBL5887426 | 0.85 | MEN1 (0.34) | CYP2D6CYP2C9HPGDALOX15CYP2C19 | |
| SCHEMBL5887320 | 0.82 | ACHE (0.33) | CYP2D6CYP2C9HPGDALOX15CYP2C19 | |
| SCHEMBL5887143 | 0.82 | PTGS2 (0.35) | CYP2D6CYP2C9HPGDALOX15CYP2C19 | |
| SCHEMBL5887105 | 0.82 | ESR2 (0.35) | — | |
| SCHEMBL6047593 | 0.81 | ALKBH3 (0.36) | CYP2D6CYP2C9HPGDALOX15CYP2C19 | |
| SCHEMBL5887353 | 0.80 | MEN1 (0.35) | HSD17B10ALKBH3 | |
| SCHEMBL5887285 | 0.77 | ALKBH3 (0.44) | CYP2C9HPGDCYP2C19HSD17B10ALKBH3 | |
| SCHEMBL5887287 | 0.77 | ACHE (0.46) | HPGDALKBH3 | |
| SCHEMBL5887347 | 0.77 | MEN1 (0.35) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2006501194-A | — | — | 2006-01-12 | — | — | JP | claimed |
| EP-1525190-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA N.V. (BE) | 2005-04-27 | — | — | EP | claimed |
| WO-2004007463-A1 | CCK-1 RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2004-01-22 | — | — | WO | claimed |